HRID1543854

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID70276

Benzoyl chloride, 2-methyl-

C8H7ClO

HCID12563768

[1,1'-Biphenyl]-2-carbonyl chloride

C13H9ClO

反应SMILES：Nc1ccc(CN2C(=O)C=C(CCO)Sc3ccccc32)cc1

HCID18387440

未命名化合物

PRODUCTS

产物

反应SMILES：Cc1ccccc1C(=O)Nc1ccc(CN2C(=O)C=C(CCO)Sc3ccccc32)cc1

HCID18387444

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD记录: ord-ee46f45cf74e4c0da3b33f67405829a7
来源数据集: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D
来源说明: Training data from https://doi.org/10.1039/C8SC04228D (1/10)

反应SMILES

[OH:1][CH2:2][CH2:3][C:4]1=[CH:10][C:9](=[O:11])[N:8]([CH2:12][c:13]2[cH:14][cH:15][c:16]([NH2:19])[cH:17][cH:18]2)[c:7]2[c:6]([cH:23][cH:22][cH:21][cH:20]2)[S:5]1.[c:24]1([CH3:33])[c:25]([C:30](=[O:31])[Cl:32])[cH:26][cH:27][cH:28][cH:29]1.[c:34]1(-[c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]2[C:41]([Cl:42])=[O:43])[cH:44][cH:45][cH:46][cH:47][cH:48]1>>[OH:1][CH2:2][CH2:3][C:4]1=[CH:10][C:9](=[O:11])[N:8]([CH2:12][c:13]2[cH:14][cH:15][c:16]([NH:19][C:30]([c:25]3[c:24]([CH3:33])[cH:29][cH:28][cH:27][cH:26]3)=[O:31])[cH:17][cH:18]2)[c:7]2[c:6]([cH:23][cH:22][cH:21][cH:20]2)[S:5]1